2-(3,4-dihydro-1H-isoquinolin-2-ylsulfonylamino)-3-oxidanyl-propanoic acid

Systemtic Name: 2-(3,4-dihydro-1H-isoquinolin-2-ylsulfonylamino)-3-oxidanyl-propanoic acid Openeye Name: 2-(3,4-dihydro-1H-isoquinolin-2-ylsulfonylamino)-3-hydroxy-propanoic acid CAS Name: 2-(3,4-dihydro-1H-isoquinolin-2-ylsulfonylamino)-3-hydroxypropanoic acid IUPAC Name: 2-(3,4-dihydro-1H-isoquinolin-2-ylsulfonylamino)-3-hydroxypropanoic acid Traditional Name: 2-(3,4-dihydro-1H-isoquinolin-2-ylsulfonylamino)-3-hydroxy-propionic acid Formula: C12H16N2O5S MolecularWeight: 300.33084

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)S(=O)(=O)NC(CO)C(=O)O

Isomeric SMILES

C1CN(CC2=CC=CC=C21)S(=O)(=O)NC(CO)C(=O)O

InChI

InChI=1S/C12H16N2O5S/c15-8-11(12(16)17)13-20(18,19)14-6-5-9-3-1-2-4-10(9)7-14/h1-4,11,13,15H,5-8H2,(H,16,17)